"Twins" retrives similar metabolites in chemical structure.
last update : 2020.01.06
KNApSAcK CID : ex.) C00000001


and

Similarity (%) : ex.) 98
% or more




INPUT WORD = C00007668 , 50% or more
[ Metabolite Name : 3,4-Epithiobutyl nitrile ]
Number of matched data : 56

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00007666 3-Hydroxybutyl nitrile 83.33
C00032372 trans-3-Methylthioacrylamide 76.92
C00001428 Putrescine 75.00
C00019656 4-Aminobutanal
gamma-Aminobutyraldehyde		 75.00
C00001194 3-(Methylthio)propionic acid 69.23
C00001337 GABA
Gamma-aminobutyric acid
4-Aminobutyric acid
gamma-Aminobutyric acid		 69.23
C00001403 Cadaverine 69.23
C00001413 Hexylamine 69.23
C00018267 (S)-2-Amino-3-butynoic acid
(S)-Ethynylglycine
Antibiotic FR 900130
FR 900130		 69.23
C00032371 trans-3-Methylsulfinyl-2-propenol
(+)-trans-3-Methylsulfinyl-2-propenol		 69.23
C00034230 Selenocysteine 69.23
C00034611 N-Methylputrescine 69.23
C00001257 Methyl allyl disulfide 66.67
C00001266 Propanethial S-oxide 66.67
C00001297 Triacetylene 66.67
C00001333 beta-Alanine 66.67
C00001350 L-beta-Cyanoalanine 66.67
C00015490 Penitricin D 66.67
C00035784 1-Pentanol
n-Pentanol		 66.67
C00035905 2-Methyl-3-buten-2-ol 66.67
C00038233 2-Pyrrolidone
2-Pyrrolidinone		 66.67
C00043612 Isobutyramide 66.67
C00046784 Isoprene 66.67
C00048949 Isovaleraldehyde
3-Methyl-butanal
3-Methylbutanal
3-methylbutanal		 66.67
C00049006 n-Hexane 66.67
C00001343 acetidine 2-carboxylic acid
Azetidine-2-carboxylic acid
(2S)-2-Azetidinecarboxylic acid
L-Azetidine 2-carboxylic acid		 64.29
C00029568 5-Hydroxypyrrolidin-2-one 64.29
C00039855 N-Methyl-2-pyrrolidone 64.29
C00044142 Cyclohexylamine 64.29
C00000351 (2E)-2-Hexanal
trans-2-Hexenal
(2E)-Hexenal		 61.54
C00000354 trans-2-Hexenol 61.54
C00000355 trans-3-Hexenol
(E)-3-Hexen-1-ol
(E)-3-Hexenol
trans-3-Hexen-1-ol		 61.54
C00000357 Hexanal
n-Hexanal
Hexenal		 61.54
C00000358 Hexan-1-ol
1-Hexanol
Hexanol
n-Hexanol		 61.54
C00001189 3-Methylbutyric acid
Isovaleric acid
3-Methylbutanoic acid		 61.54
C00001208 Valeric acid
pentanoic acid		 61.54
C00001244 Diallyl sulfide 61.54
C00001351 L-Cysteine
L-Cys		 61.54
C00001412 Gyromitrin 61.54
C00007323 D-Cysteine 61.54
C00019675 2-Ketobutyric acid
2-Oxobutyric acid
2-Oxobutanoic acid
alpha-Ketobutyric acid		 61.54
C00019682 Succinaldehydic acid
beta-Formylpropionic acid
4-Oxobutanoic acid		 61.54
C00033067 Isovalerate 61.54
C00033555 2-Methyl-1,3-butanediol 61.54
C00035479 2-Hexen-1-ol 61.54
C00035480 (2E)-Hex-2-enal
2-Hexenal
(E)-Hex-2-enal		 61.54
C00035484 2-methylhexane 61.54
C00035493 3-Methyl-2-pentanol 61.54
C00035617 Ethyl propionate
Ethyl propanoate		 61.54
C00035792 3-Methyl-1-pentanol
3-Methylbutanol		 61.54
C00036428 1-Deoxythreitol 61.54
C00036488 2-Hexanol 61.54
C00036546 3-Hexen-1-ol 61.54
C00036556 3-Methyl-butanamide 61.54
C00043175 2-Methylbutyramide 61.54
C00048948 3-Hexenal 61.54
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